HuagongsheHuagongshe Chemistry Print Report · For research reference only
3-Bromo-2-chloro-4-(4-chlorophenyl)-6-methylpyridine
Identifiers & Physical Properties
| CAS No. | 917969-66-5 |
|---|---|
| Molecular formula | C12H8BrCl2N |
| Average molar mass | 317 g/mol |
| Monoisotopic mass | 314.92171672 g/mol |
| SMILES | Cc1cc(-c2ccc(Cl)cc2)c(Br)c(Cl)n1 |
| InChIKey | NPBHGLVIAOGANJ-UHFFFAOYSA-N |
| PubChem CID | 57799430 |
| DTXSID | DTXSID80727940 |
Chemical & Physical Properties
| XLogP | 5.2 |
|---|---|
| Topological polar surface area | 12.9 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 1 |
| Rotatable bonds | 1 |
| Heavy atoms | 16 |
| Formal charge | 0 |
| Complexity | 231 |